2-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]ethyl methanesulfonate

Systemtic Name: 2-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]ethyl methanesulfonate Openeye Name: 2-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]ethyl ester IUPAC Name: 2-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]ethyl ester Formula: C13H14N4O3S MolecularWeight: 306.34026

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCC1=CNC2=C1C=C(C=C2)N3C=NN=C3

Isomeric SMILES

CS(=O)(=O)OCCC1=CNC2=C1C=C(C=C2)N3C=NN=C3

InChI

InChI=1S/C13H14N4O3S/c1-21(18,19)20-5-4-10-7-14-13-3-2-11(6-12(10)13)17-8-15-16-9-17/h2-3,6-9,14H,4-5H2,1H3